==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=7-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 20-FEB-08 3CAV . COMPND 2 MOLECULE: 3-OXO-5-BETA-STEROID 4-DEHYDROGENASE; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR F.FAUCHER,L.CANTIN,R.BRETON . 650 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 28424.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 409 62.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 70 10.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 21 3.2 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 4 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-1), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+0), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+1), SAME NUMBER PER 100 RESIDUES . 30 4.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 76 11.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 174 26.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 14 2.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES . 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 *** HISTOGRAMS OF *** . 0 0 0 0 0 1 0 5 2 2 2 3 3 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 4 6 2 2 4 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 5 1 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 3 0 0 0 0 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 LADDERS PER SHEET . # RESIDUE AA STRUCTURE BP1 BP2 ACC N-H-->O O-->H-N N-H-->O O-->H-N TCO KAPPA ALPHA PHI PSI X-CA Y-CA Z-CA 1 2 A D 0 0 194 0, 0.0 2,-0.4 0, 0.0 5,-0.0 0.000 360.0 360.0 360.0 -36.3 -8.5 8.5 -48.1 2 3 A L + 0 0 35 5,-0.1 2,-0.3 3,-0.0 5,-0.2 -0.770 360.0 165.0 -95.5 136.1 -5.5 10.8 -47.9 3 4 A S - 0 0 50 3,-1.9 284,-0.1 -2,-0.4 3,-0.0 -0.923 51.2-103.5-142.1 166.1 -2.6 10.4 -50.2 4 5 A A S S+ 0 0 54 -2,-0.3 3,-0.2 1,-0.2 -1,-0.1 0.864 123.4 44.5 -58.7 -36.1 0.4 12.5 -51.3 5 6 A A S S+ 0 0 102 1,-0.3 2,-0.4 -3,-0.0 -1,-0.2 0.785 125.9 26.4 -79.7 -30.2 -1.3 13.3 -54.6 6 7 A S + 0 0 80 1,-0.1 -3,-1.9 -3,-0.0 -1,-0.3 -0.874 65.4 131.8-140.8 104.8 -4.8 14.0 -53.1 7 8 A H + 0 0 11 -2,-0.4 12,-2.4 -5,-0.2 2,-0.4 0.051 26.8 130.9-142.4 32.0 -5.3 15.3 -49.5 8 9 A R E -A 18 0A 100 10,-0.3 8,-0.0 11,-0.1 -2,-0.0 -0.754 38.3-156.5 -91.5 132.4 -7.6 18.3 -49.6 9 10 A I E -A 17 0A 28 8,-2.5 8,-2.4 -2,-0.4 2,-0.1 -0.786 26.0 -92.6-107.6 151.3 -10.5 18.3 -47.1 10 11 A P E -A 16 0A 107 0, 0.0 2,-0.3 0, 0.0 6,-0.3 -0.326 27.8-155.1 -68.2 138.4 -13.8 20.2 -47.4 11 12 A L > - 0 0 10 4,-3.2 3,-1.6 -2,-0.1 202,-0.1 -0.788 31.7-111.6-104.4 152.8 -14.5 23.6 -45.9 12 13 A S T 3 S+ 0 0 53 200,-0.5 201,-0.1 -2,-0.3 175,-0.1 0.655 111.7 62.7 -61.7 -18.3 -18.1 24.6 -45.1 13 14 A D T 3 S- 0 0 46 2,-0.1 -1,-0.3 174,-0.0 3,-0.1 0.263 123.9 -94.8 -91.8 13.3 -18.2 27.3 -47.9 14 15 A G S < S+ 0 0 73 -3,-1.6 -2,-0.1 1,-0.3 2,-0.1 0.291 94.8 105.7 95.5 -12.8 -17.8 24.7 -50.7 15 16 A N - 0 0 61 148,-0.1 -4,-3.2 -5,-0.1 -1,-0.3 -0.284 57.8-137.1 -90.8-179.8 -14.0 25.2 -50.9 16 17 A S E -A 10 0A 36 -6,-0.3 -8,-0.1 -3,-0.1 -1,-0.0 -0.931 5.2-149.1-139.1 162.7 -11.2 22.8 -49.7 17 18 A I E -A 9 0A 2 -8,-2.4 -8,-2.5 -2,-0.3 2,-0.2 -0.997 26.5-112.6-137.1 135.3 -7.9 22.9 -47.9 18 19 A P E -A 8 0A 1 0, 0.0 -10,-0.3 0, 0.0 30,-0.0 -0.479 28.5-132.5 -65.2 130.6 -4.7 20.7 -48.2 19 20 A I S S+ 0 0 1 -12,-2.4 250,-2.2 -2,-0.2 2,-0.4 0.592 89.5 43.1 -63.5 -12.7 -4.4 18.9 -44.9 20 21 A I B +b 269 0B 0 248,-0.2 29,-0.5 -13,-0.1 30,-0.3 -1.000 67.7 167.4-135.1 137.3 -0.7 19.7 -44.6 21 22 A G - 0 0 0 248,-2.2 2,-0.6 -2,-0.4 30,-0.3 -0.914 37.8-100.1-141.0 167.6 1.0 23.1 -45.3 22 23 A L E -c 51 0B 0 28,-2.3 30,-2.5 -2,-0.3 250,-0.2 -0.826 31.6-143.1 -95.5 122.5 4.3 24.8 -44.7 23 24 A G E -cd 52 272B 5 248,-2.0 250,-0.6 -2,-0.6 30,-0.1 -0.525 12.5-168.5 -78.6 150.7 4.5 27.2 -41.8 24 25 A T + 0 0 1 28,-0.8 2,-0.3 -2,-0.2 30,-0.1 0.265 37.4 123.6-129.0 15.5 6.7 30.3 -42.3 25 26 A Y + 0 0 93 27,-0.1 2,-0.3 28,-0.1 33,-0.1 -0.603 30.7 162.3 -77.0 140.3 7.3 32.2 -39.1 26 27 A S - 0 0 17 31,-0.3 5,-0.1 -2,-0.3 10,-0.0 -0.937 51.1 -87.7-158.3 134.0 11.0 32.6 -38.3 27 28 A E >> - 0 0 63 -2,-0.3 3,-1.0 1,-0.1 4,-1.0 -0.196 39.9-149.3 -46.9 107.2 12.8 35.0 -35.9 28 29 A P G >4 S+ 0 0 59 0, 0.0 3,-1.1 0, 0.0 -1,-0.1 0.896 88.7 50.6 -44.7 -61.7 13.4 38.1 -38.1 29 30 A K G 34 S+ 0 0 176 1,-0.2 -2,-0.1 3,-0.0 0, 0.0 0.715 119.9 35.7 -55.2 -26.2 16.6 39.4 -36.6 30 31 A S G <4 S+ 0 0 69 -3,-1.0 -1,-0.2 2,-0.1 -3,-0.1 0.406 93.3 95.7-112.4 1.9 18.4 36.1 -36.9 31 32 A T S << S- 0 0 30 -3,-1.1 3,-0.1 -4,-1.0 5,-0.0 -0.830 74.8-122.0 -99.0 124.1 17.0 34.6 -40.1 32 33 A P > - 0 0 94 0, 0.0 3,-1.7 0, 0.0 4,-0.3 -0.346 35.3-102.5 -62.7 138.3 19.1 35.1 -43.3 33 34 A K T 3 S+ 0 0 187 1,-0.2 26,-0.0 2,-0.1 0, 0.0 -0.332 106.6 28.6 -59.8 140.4 17.2 36.9 -46.0 34 35 A G T 3> S+ 0 0 28 -3,-0.1 4,-2.3 25,-0.0 -1,-0.2 0.165 85.6 108.3 94.7 -18.4 16.0 34.5 -48.7 35 36 A A H <> S+ 0 0 22 -3,-1.7 4,-2.2 1,-0.2 5,-0.1 0.895 79.9 49.0 -59.2 -41.4 15.7 31.4 -46.4 36 37 A C H > S+ 0 0 3 -4,-0.3 4,-2.3 2,-0.2 5,-0.2 0.966 110.4 49.2 -63.6 -52.3 11.9 31.6 -46.6 37 38 A A H > S+ 0 0 9 1,-0.2 4,-1.8 2,-0.2 -2,-0.2 0.897 112.2 49.1 -53.9 -45.1 11.7 31.8 -50.4 38 39 A T H X S+ 0 0 81 -4,-2.3 4,-2.0 1,-0.2 -1,-0.2 0.918 110.9 50.3 -61.8 -44.1 14.1 28.9 -50.8 39 40 A S H X S+ 0 0 4 -4,-2.2 4,-2.3 1,-0.2 -2,-0.2 0.849 108.3 51.4 -64.9 -37.2 12.1 26.8 -48.3 40 41 A V H X S+ 0 0 0 -4,-2.3 4,-2.4 2,-0.2 -1,-0.2 0.891 109.5 50.7 -68.2 -38.2 8.7 27.4 -50.0 41 42 A K H X S+ 0 0 53 -4,-1.8 4,-2.1 -5,-0.2 -2,-0.2 0.917 111.4 48.0 -65.1 -41.6 10.2 26.4 -53.4 42 43 A V H X S+ 0 0 27 -4,-2.0 4,-2.1 2,-0.2 -2,-0.2 0.917 110.3 52.7 -63.9 -43.2 11.5 23.2 -51.9 43 44 A A H X>S+ 0 0 0 -4,-2.3 5,-2.3 1,-0.2 4,-1.6 0.941 109.7 47.6 -57.9 -49.5 8.2 22.5 -50.2 44 45 A I H <5S+ 0 0 0 -4,-2.4 3,-0.3 1,-0.2 -1,-0.2 0.901 111.0 51.0 -60.8 -41.2 6.3 22.9 -53.5 45 46 A D H <5S+ 0 0 82 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.866 109.5 53.0 -62.7 -35.6 8.8 20.6 -55.3 46 47 A T H <5S- 0 0 20 -4,-2.1 -1,-0.2 -5,-0.2 -2,-0.2 0.776 130.3 -91.4 -70.2 -30.2 8.3 18.0 -52.5 47 48 A G T <5S+ 0 0 17 -4,-1.6 -3,-0.2 1,-0.3 -2,-0.1 0.354 76.4 140.5 134.3 -6.3 4.5 18.0 -52.9 48 49 A Y < + 0 0 0 -5,-2.3 -1,-0.3 -6,-0.2 -27,-0.1 -0.413 19.4 174.6 -66.3 142.5 3.2 20.7 -50.5 49 50 A R + 0 0 61 -29,-0.5 33,-2.2 1,-0.1 2,-0.4 0.243 59.0 71.7-131.4 9.8 0.3 22.8 -51.9 50 51 A H E - e 0 82B 3 -30,-0.3 -28,-2.3 31,-0.2 2,-0.4 -0.996 54.8-176.4-132.0 130.6 -0.6 24.8 -48.8 51 52 A I E -ce 22 83B 0 31,-2.5 33,-1.9 -2,-0.4 2,-0.5 -0.997 9.7-156.6-128.8 131.4 1.5 27.7 -47.4 52 53 A D E +ce 23 84B 4 -30,-2.5 -28,-0.8 -2,-0.4 2,-0.2 -0.931 30.7 136.8-111.3 128.9 0.7 29.6 -44.1 53 54 A G - 0 0 0 31,-2.1 2,-0.3 -2,-0.5 3,-0.1 -0.837 32.1-145.9-151.4-170.6 2.1 33.1 -43.5 54 55 A A > - 0 0 0 -2,-0.2 3,-1.9 31,-0.2 5,-0.4 -0.947 29.1-119.7-166.9 144.1 1.4 36.6 -42.3 55 56 A Y G > S+ 0 0 85 31,-0.5 3,-1.6 -2,-0.3 5,-0.4 0.883 113.2 58.9 -55.2 -38.5 2.4 40.2 -43.1 56 57 A I G 3 S+ 0 0 16 1,-0.3 -1,-0.3 30,-0.2 74,-0.0 0.575 85.1 76.9 -70.6 -8.2 3.8 40.6 -39.6 57 58 A Y G < S- 0 0 35 -3,-1.9 -1,-0.3 1,-0.1 -31,-0.3 0.559 99.5-134.1 -76.0 -7.3 6.2 37.6 -40.1 58 59 A Q S < S+ 0 0 106 -3,-1.6 -2,-0.1 -4,-0.2 -3,-0.1 0.397 89.8 75.4 71.5 -1.9 8.3 40.2 -42.1 59 60 A N >> + 0 0 14 -5,-0.4 4,-1.2 1,-0.1 3,-0.8 0.145 48.1 117.5-125.6 19.6 8.8 37.7 -44.9 60 61 A E H 3> S+ 0 0 3 -5,-0.4 4,-1.6 -6,-0.3 5,-0.1 0.830 75.7 59.3 -58.6 -30.3 5.4 37.6 -46.7 61 62 A H H 3> S+ 0 0 81 1,-0.2 4,-2.2 2,-0.2 -1,-0.3 0.872 100.0 55.5 -67.1 -34.8 7.1 38.9 -49.9 62 63 A E H <> S+ 0 0 16 -3,-0.8 4,-2.0 1,-0.2 -1,-0.2 0.855 104.2 54.6 -65.2 -33.3 9.5 35.9 -50.0 63 64 A V H X S+ 0 0 0 -4,-1.2 4,-2.3 1,-0.2 -1,-0.2 0.926 109.3 47.4 -65.4 -43.6 6.4 33.6 -50.0 64 65 A G H X S+ 0 0 0 -4,-1.6 4,-2.8 1,-0.2 5,-0.2 0.899 108.2 54.7 -64.1 -41.5 5.0 35.4 -53.0 65 66 A E H X S+ 0 0 83 -4,-2.2 4,-1.9 1,-0.2 -1,-0.2 0.924 111.2 45.2 -57.0 -47.9 8.3 35.3 -54.9 66 67 A A H X S+ 0 0 0 -4,-2.0 4,-2.1 2,-0.2 -2,-0.2 0.926 113.5 48.5 -63.1 -48.6 8.5 31.5 -54.5 67 68 A I H X S+ 0 0 0 -4,-2.3 4,-1.4 1,-0.2 -2,-0.2 0.921 113.8 46.7 -59.8 -45.0 4.9 30.9 -55.4 68 69 A R H X S+ 0 0 73 -4,-2.8 4,-1.9 1,-0.2 -1,-0.2 0.838 110.2 53.3 -68.2 -31.8 5.1 33.1 -58.5 69 70 A E H X S+ 0 0 86 -4,-1.9 4,-1.5 -5,-0.2 -1,-0.2 0.904 109.4 48.1 -69.4 -40.4 8.4 31.5 -59.6 70 71 A K H <>S+ 0 0 9 -4,-2.1 5,-1.8 2,-0.2 6,-1.1 0.771 111.4 50.4 -71.4 -26.1 7.0 28.0 -59.4 71 72 A I H ><5S+ 0 0 53 -4,-1.4 3,-0.7 2,-0.2 -1,-0.2 0.873 110.8 49.0 -76.7 -38.2 3.9 29.1 -61.4 72 73 A A H 3<5S+ 0 0 88 -4,-1.9 -2,-0.2 1,-0.2 -1,-0.2 0.791 106.8 57.2 -69.7 -27.8 6.2 30.6 -64.1 73 74 A E T 3<5S- 0 0 106 -4,-1.5 -1,-0.2 -5,-0.1 -2,-0.2 0.652 113.8-121.1 -75.6 -16.4 8.1 27.4 -64.1 74 75 A G T < 5S+ 0 0 64 -3,-0.7 -3,-0.2 -4,-0.3 -2,-0.1 0.552 79.3 122.9 86.0 8.3 4.9 25.5 -65.0 75 76 A K S > - 0 0 144 -2,-0.3 3,-2.2 -3,-0.1 4,-0.7 -0.751 36.4-107.0-106.0 157.5 -1.1 26.7 -61.5 78 79 A R G >4 S+ 0 0 35 1,-0.3 3,-1.3 -2,-0.3 -1,-0.1 0.881 121.7 56.3 -50.2 -41.6 -2.4 29.5 -59.2 79 80 A E G 34 S+ 0 0 103 1,-0.3 -1,-0.3 3,-0.1 -3,-0.0 0.632 98.7 61.1 -66.9 -15.5 -5.5 27.3 -58.5 80 81 A D G <4 S+ 0 0 46 -3,-2.2 2,-0.3 2,-0.0 -1,-0.3 0.635 95.4 76.4 -84.8 -16.3 -3.3 24.5 -57.3 81 82 A I << - 0 0 1 -3,-1.3 2,-0.5 -4,-0.7 -31,-0.2 -0.772 62.3-159.5-102.1 142.2 -1.9 26.6 -54.5 82 83 A F E -e 50 0B 3 -33,-2.2 -31,-2.5 -2,-0.3 2,-0.4 -0.968 12.4-176.6-121.6 114.0 -3.5 27.5 -51.2 83 84 A Y E -e 51 0B 0 -2,-0.5 32,-1.8 -33,-0.2 31,-1.1 -0.936 9.5-159.6-114.6 135.9 -2.2 30.5 -49.3 84 85 A C E -ef 52 115B 1 -33,-1.9 -31,-2.1 -2,-0.4 2,-0.3 -0.951 12.4-178.0-114.0 128.7 -3.5 31.7 -45.9 85 86 A G E - f 0 116B 0 30,-2.7 32,-1.8 -2,-0.5 2,-0.4 -0.773 13.4-136.5-118.6 166.8 -2.8 35.3 -44.7 86 87 A K E - f 0 117B 5 -2,-0.3 2,-0.7 30,-0.2 -31,-0.5 -0.976 8.7-137.6-136.4 144.6 -3.7 37.0 -41.4 87 88 A L E - 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0 0 20 -5,-1.5 -1,-0.3 -6,-0.1 -2,-0.1 -0.881 66.4-130.3-126.6 158.5 -1.3 38.1 -56.4 111 112 A D S S+ 0 0 143 -2,-0.3 2,-0.3 1,-0.2 -6,-0.1 0.721 83.9 0.8 -82.3 -24.9 -5.0 38.9 -57.1 112 113 A Y - 0 0 43 -7,-0.1 2,-0.3 50,-0.0 50,-0.2 -0.982 60.3-127.9-157.4 164.3 -6.4 37.0 -54.1 113 114 A V E - g 0 162B 0 48,-1.7 50,-1.8 -2,-0.3 51,-0.2 -0.887 18.4-137.0-114.9 151.5 -5.6 34.9 -51.0 114 115 A D E S+ 0 0 14 -31,-1.1 50,-1.6 -2,-0.3 2,-0.3 0.855 88.6 14.2 -77.0 -34.7 -7.3 31.5 -50.4 115 116 A L E -fg 84 164B 3 -32,-1.8 -30,-2.7 48,-0.2 2,-0.4 -0.994 62.0-175.9-144.2 132.6 -7.9 32.1 -46.7 116 117 A Y E -fg 85 165B 0 48,-1.7 50,-1.9 -2,-0.3 2,-0.3 -0.999 15.4-178.3-129.1 129.2 -7.7 35.3 -44.6 117 118 A I E -fg 86 166B 0 -32,-1.8 -30,-2.8 -2,-0.4 2,-0.7 -0.923 36.8-106.1-132.3 155.7 -8.2 35.1 -40.9 118 119 A I E -fg 87 167B 0 48,-1.4 50,-1.3 -2,-0.3 -30,-0.1 -0.715 33.6-148.8 -78.3 114.9 -8.4 37.4 -37.8 119 120 A E S S- 0 0 14 -32,-2.0 -1,-0.2 -2,-0.7 -31,-0.1 0.798 72.4 -1.5 -56.9 -40.0 -5.0 36.6 -36.2 120 121 A V - 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0 0 33 -5,-3.0 -1,-0.3 -8,-0.1 -2,-0.1 -0.875 63.6-105.0-131.4 161.3 4.8 16.2 17.5 579 254 B T > - 0 0 53 -2,-0.3 4,-1.6 28,-0.1 5,-0.1 -0.381 33.8-107.0 -83.1 167.8 2.3 18.4 15.7 580 255 B A H > S+ 0 0 5 -16,-0.2 4,-2.4 1,-0.2 5,-0.2 0.919 121.5 57.4 -60.2 -41.7 -1.5 17.9 15.8 581 256 B A H > S+ 0 0 7 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.919 105.3 49.5 -54.6 -46.7 -1.3 16.5 12.3 582 257 B Q H > S+ 0 0 17 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.831 109.6 52.7 -63.5 -32.8 1.2 13.9 13.3 583 258 B I H X S+ 0 0 0 -4,-1.6 4,-2.1 -3,-0.2 -1,-0.2 0.908 109.3 47.4 -70.1 -42.2 -1.0 12.8 16.2 584 259 B V H X S+ 0 0 1 -4,-2.4 4,-1.5 2,-0.2 -2,-0.2 0.857 112.3 49.9 -69.8 -32.7 -4.1 12.3 14.1 585 260 B L H X S+ 0 0 0 -4,-1.9 4,-2.1 -5,-0.2 5,-0.2 0.915 111.0 48.4 -71.0 -41.0 -2.2 10.3 11.5 586 261 B R H X S+ 0 0 26 -4,-1.9 4,-2.5 1,-0.2 5,-0.2 0.907 104.8 62.3 -64.4 -39.8 -0.7 8.0 14.1 587 262 B F H X S+ 0 0 1 -4,-2.1 4,-0.5 1,-0.2 -1,-0.2 0.936 109.0 39.3 -49.8 -54.5 -4.2 7.6 15.6 588 263 B N H ><>S+ 0 0 1 -4,-1.5 5,-2.5 1,-0.2 3,-1.1 0.917 114.9 49.0 -69.0 -43.4 -5.5 5.9 12.5 589 264 B I H ><5S+ 0 0 3 -4,-2.1 3,-1.6 1,-0.3 -1,-0.2 0.874 105.9 58.3 -65.8 -31.6 -2.5 3.8 11.5 590 265 B Q H 3<5S+ 0 0 56 -4,-2.5 -1,-0.3 1,-0.3 -2,-0.2 0.712 105.7 52.0 -68.0 -16.8 -2.3 2.4 15.0 591 266 B R T <<5S- 0 0 50 -3,-1.1 -1,-0.3 -4,-0.5 -2,-0.2 0.433 125.3-104.3 -94.3 -5.1 -5.9 1.2 14.5 592 267 B G T < 5S+ 0 0 35 -3,-1.6 2,-0.5 -4,-0.3 -51,-0.3 0.683 77.7 137.6 87.8 19.1 -5.0 -0.5 11.2 593 268 B V < - 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0 0 91 -105,-2.2 -104,-0.2 2,-0.2 -1,-0.2 0.546 35.5-132.5-105.5 -15.2 -18.7 14.4 16.4 630 305 B N + 0 0 108 -106,-1.1 2,-0.4 1,-0.3 -105,-0.2 0.849 67.1 125.4 62.6 33.7 -20.4 12.2 13.8 631 306 B V - 0 0 51 -107,-1.0 2,-0.3 -74,-0.0 -1,-0.3 -0.992 55.0-135.2-125.0 131.4 -20.4 15.2 11.5 632 307 B R - 0 0 35 -2,-0.4 3,-0.2 1,-0.1 -72,-0.1 -0.666 13.9-160.7 -91.4 141.1 -18.9 15.0 8.0 633 308 B F S S+ 0 0 2 -2,-0.3 -76,-2.4 1,-0.2 2,-0.7 0.759 94.5 53.1 -83.0 -26.8 -16.6 17.5 6.4 634 309 B V + 0 0 6 -78,-0.2 -1,-0.2 1,-0.2 -114,-0.1 -0.828 60.6 145.9-113.9 94.5 -17.6 15.9 3.1 635 310 B E - 0 0 60 -2,-0.7 12,-0.2 -80,-0.3 -1,-0.2 0.768 35.5-156.2 -96.6 -33.2 -21.4 15.8 2.7 636 311 B L > + 0 0 32 -81,-0.4 3,-2.0 1,-0.1 4,-0.1 0.903 21.8 173.5 54.9 44.7 -21.8 16.3 -1.1 637 312 B L G > + 0 0 82 1,-0.3 3,-1.9 2,-0.2 4,-0.2 0.747 63.9 73.8 -55.9 -28.5 -25.4 17.6 -0.5 638 313 B M G 3 S+ 0 0 79 1,-0.3 -1,-0.3 2,-0.1 -173,-0.2 0.648 102.3 43.1 -64.0 -11.2 -25.9 18.5 -4.1 639 314 B W G X S+ 0 0 18 -3,-2.0 3,-1.9 1,-0.1 -1,-0.3 0.213 76.8 111.8-115.9 12.8 -26.3 14.8 -4.9 640 315 B R T < S+ 0 0 120 -3,-1.9 5,-0.2 1,-0.3 -2,-0.1 0.661 73.2 61.8 -60.2 -16.9 -28.5 13.9 -1.9 641 316 B D T 3 S+ 0 0 109 -4,-0.2 -1,-0.3 -3,-0.2 -2,-0.1 0.550 76.8 105.1 -88.1 -10.0 -31.3 13.2 -4.4 642 317 B H S X S- 0 0 6 -3,-1.9 3,-2.2 1,-0.1 -3,-0.0 -0.538 79.6-123.7 -73.2 137.8 -29.6 10.5 -6.3 643 318 B P T 3 S+ 0 0 107 0, 0.0 -1,-0.1 0, 0.0 -174,-0.0 0.740 110.3 50.0 -51.8 -27.7 -31.0 7.0 -5.4 644 319 B E T 3 S+ 0 0 27 -195,-0.1 -196,-0.1 -198,-0.0 -3,-0.1 0.101 71.1 143.5-102.6 23.4 -27.5 5.8 -4.4 645 320 B Y X - 0 0 15 -3,-2.2 3,-0.5 -5,-0.2 -5,-0.1 -0.493 39.0-155.2 -61.2 125.3 -26.6 8.7 -2.1 646 321 B P T 3 S+ 0 0 5 0, 0.0 3,-0.2 0, 0.0 -1,-0.1 0.647 74.5 66.8 -80.8 -18.3 -24.6 6.8 0.6 647 322 B F T 3 S+ 0 0 32 1,-0.2 -2,-0.1 -12,-0.2 -7,-0.0 0.197 74.7 82.0 -95.9 18.5 -25.0 9.1 3.6 648 323 B H S < S+ 0 0 106 -3,-0.5 -1,-0.2 3,-0.0 -8,-0.0 0.918 82.8 71.9 -81.2 -46.5 -28.8 8.9 4.4 649 324 B D S S- 0 0 74 -3,-0.2 0, 0.0 1,-0.1 0, 0.0 -0.124 97.6-107.7 -64.3 163.7 -28.3 5.6 6.3 650 325 B E 0 0 138 1,-0.1 -121,-0.1 -121,-0.0 -1,-0.1 0.865 360.0 360.0 -59.1 -39.4 -26.7 5.4 9.8 651 326 B Y 0 0 62 -122,-0.1 -153,-1.9 -121,-0.0 -1,-0.1 0.238 360.0 360.0-173.1 360.0 -23.7 3.8 8.1